(3R)-3-imidazol-1-yl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]hexanamide

C19H25N3O — CID 41082816

IUPAC(3R)-3-imidazol-1-yl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]hexanamide
SMILESCCC[C@H](CC(=O)N[C@@H]1CCCc2ccccc21)n1ccnc1
InChIInChI=1S/C19H25N3O/c1-2-6-16(22-12-11-20-14-22)13-19(23)21-18-10-5-8-15-7-3-4-9-17(15)18/h3-4,7,9,11-12,14,16,18H,2,5-6,8,10,13H2,1H3,(H,21,23)/t16-,18-/m1/s1
InChIKeyCNAKWJOKFULJSJ-SJLPKXTDSA-N
MW311.43 g/mol
LogP3.81
Rot. Bonds6

About (3R)-3-imidazol-1-yl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]hexanamide

(3R)-3-imidazol-1-yl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]hexanamide (PubChem CID 41082816) has the molecular formula C19H25N3O and a molecular weight of 311.43 g/mol. Its IUPAC name is (3R)-3-imidazol-1-yl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]hexanamide.

Molecular Properties

Compound Name(3R)-3-imidazol-1-yl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]hexanamide
PubChem CID41082816
Molecular FormulaC19H25N3O
Molecular Weight311.43 g/mol
Exact Mass311.20
IUPAC Name(3R)-3-imidazol-1-yl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]hexanamide
SMILESCCC[C@H](CC(=O)N[C@@H]1CCCc2ccccc21)n1ccnc1
InChIInChI=1S/C19H25N3O/c1-2-6-16(22-12-11-20-14-22)13-19(23)21-18-10-5-8-15-7-3-4-9-17(15)18/h3-4,7,9,11-12,14,16,18H,2,5-6,8,10,13H2,1H3,(H,21,23)/t16-,18-/m1/s1
InChIKeyCNAKWJOKFULJSJ-SJLPKXTDSA-N
XLogP3.81
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.43
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3R)-3-imidazol-1-yl-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]hexanamide
CID 41082819
2-imidazol-1-yl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide
CID 17491802
3-methyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pentanamide
CID 144973530
N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]dodecanamide
CID 23624795
3-methylsulfanyl-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]propanamide
CID 51456009
4-pyrazol-1-yl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]butanamide
CID 94821272
4-amino-3-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)butanamide
CID 81076134
2-(1-methylpiperidin-4-yl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide
CID 133204363
3-imidazol-1-yl-1-phenylhexan-1-one
CID 19825175
3-bromo-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]propanamide
CID 69220088
3-amino-3-phenyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)propanamide
CID 119948742
4-amino-3-methoxy-N-(1,2,3,4-tetrahydronaphthalen-1-yl)butanamide;hydrochloride
CID 120586516

Frequently Asked Questions

What is the IUPAC name of (3R)-3-imidazol-1-yl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]hexanamide?
The IUPAC name of (3R)-3-imidazol-1-yl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]hexanamide (CID 41082816) is (3R)-3-imidazol-1-yl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]hexanamide.
What is the SMILES notation for (3R)-3-imidazol-1-yl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]hexanamide?
The canonical SMILES for (3R)-3-imidazol-1-yl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]hexanamide is CCC[C@H](CC(=O)N[C@@H]1CCCc2ccccc21)n1ccnc1.
What is the InChIKey of (3R)-3-imidazol-1-yl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]hexanamide?
The InChIKey is CNAKWJOKFULJSJ-SJLPKXTDSA-N. The full InChI is InChI=1S/C19H25N3O/c1-2-6-16(22-12-11-20-14-22)13-19(23)21-18-10-5-8-15-7-3-4-9-17(15)18/h3-4,7,9,11-12,14,16,18H,2,5-6,8,10,13H2,1H3,(H,21,23)/t16-,18-/m1/s1.
What are the key properties of (3R)-3-imidazol-1-yl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]hexanamide?
(3R)-3-imidazol-1-yl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]hexanamide has a molecular weight of 311.43 g/mol, XLogP of 3.81, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-imidazol-1-yl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]hexanamide is sourced from PubChem (CID 41082816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).